N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-naphthalen-2-yloxypyrimidin-4-amine

C20H17N5O — CID 20604204

IUPACN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-naphthalen-2-yloxypyrimidin-4-amine
SMILESc1ccc2cc(Oc3nccc(Nc4cc(C5CC5)[nH]n4)n3)ccc2c1
InChIInChI=1S/C20H17N5O/c1-2-4-15-11-16(8-7-13(15)3-1)26-20-21-10-9-18(23-20)22-19-12-17(24-25-19)14-5-6-14/h1-4,7-12,14H,5-6H2,(H2,21,22,23,24,25)
InChIKeyAIDIBRPYNAZXRA-UHFFFAOYSA-N
MW343.39 g/mol
LogP4.77
Rot. Bonds5

About N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-naphthalen-2-yloxypyrimidin-4-amine

N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-naphthalen-2-yloxypyrimidin-4-amine (PubChem CID 20604204) has the molecular formula C20H17N5O and a molecular weight of 343.39 g/mol. Its IUPAC name is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-naphthalen-2-yloxypyrimidin-4-amine.

Molecular Properties

Compound NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-naphthalen-2-yloxypyrimidin-4-amine
PubChem CID20604204
Molecular FormulaC20H17N5O
Molecular Weight343.39 g/mol
Exact Mass343.14
IUPAC NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-naphthalen-2-yloxypyrimidin-4-amine
SMILESc1ccc2cc(Oc3nccc(Nc4cc(C5CC5)[nH]n4)n3)ccc2c1
InChIInChI=1S/C20H17N5O/c1-2-4-15-11-16(8-7-13(15)3-1)26-20-21-10-9-18(23-20)22-19-12-17(24-25-19)14-5-6-14/h1-4,7-12,14H,5-6H2,(H2,21,22,23,24,25)
InChIKeyAIDIBRPYNAZXRA-UHFFFAOYSA-N
XLogP4.77
TPSA75.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 54.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[4-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]-3-(4-methoxyphenyl)urea
CID 118888864
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(3-ethylphenyl)pyrimidin-4-amine
CID 90243458
6-(2,6-dimethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)-2-naphthalen-2-yloxypyrimidin-4-amine
CID 20604139
5-bromo-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-(4-phenoxyphenyl)pyrimidine-2,4-diamine
CID 59758147
phenyl N-[4-[[4-[(5-cyclopentyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]cyclohexyl]carbamate
CID 154687395
(E)-3-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]prop-2-ene-1-sulfonamide
CID 58169227
3-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]prop-2-ene-1-sulfinate
CID 77491619
4-N-(5-cyclopentyl-1H-pyrazol-3-yl)-2-N-(1-cyclopropylpiperidin-4-yl)pyrimidine-2,4-diamine
CID 171637789
4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl]pyrimidine-2,4-diamine
CID 59758109
2-N-[4-(2-aminopropan-2-yl)phenyl]-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine
CID 71058238
4-N-(5-cyclopentyl-1H-pyrazol-3-yl)-2-N-methylpyrimidine-2,4-diamine;ethane;methylcyclohexane
CID 154687415
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(4-phenoxyphenyl)acetamide
CID 22176647

Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-naphthalen-2-yloxypyrimidin-4-amine?
The IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-naphthalen-2-yloxypyrimidin-4-amine (CID 20604204) is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-naphthalen-2-yloxypyrimidin-4-amine.
What is the SMILES notation for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-naphthalen-2-yloxypyrimidin-4-amine?
The canonical SMILES for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-naphthalen-2-yloxypyrimidin-4-amine is c1ccc2cc(Oc3nccc(Nc4cc(C5CC5)[nH]n4)n3)ccc2c1.
What is the InChIKey of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-naphthalen-2-yloxypyrimidin-4-amine?
The InChIKey is AIDIBRPYNAZXRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N5O/c1-2-4-15-11-16(8-7-13(15)3-1)26-20-21-10-9-18(23-20)22-19-12-17(24-25-19)14-5-6-14/h1-4,7-12,14H,5-6H2,(H2,21,22,23,24,25).
What are the key properties of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-naphthalen-2-yloxypyrimidin-4-amine?
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-naphthalen-2-yloxypyrimidin-4-amine has a molecular weight of 343.39 g/mol, XLogP of 4.77, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-naphthalen-2-yloxypyrimidin-4-amine is sourced from PubChem (CID 20604204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).